5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one

C100H140ClFN26O9 — CID 159783321

About 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one

5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 159783321) has the molecular formula C100H140ClFN26O9 and a molecular weight of 1904.84 g/mol. Its IUPAC name is 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

• Compound Name: 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one
• PubChem CID: 159783321
• Molecular Formula: C100H140ClFN26O9
• Molecular Weight: 1904.84 g/mol
• Exact Mass: 1903.10
• IUPAC Name: 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one
• SMILES: COCCc1[nH]nc2c1c(=O)n(CCCN)c1ccc(Cl)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1cc(F)c(OCCCN(C)C)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1cc(N3CCCC3)c(OCC(C)CN(C)C)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(OCCC3CCCN3C)cc21.Cc1cc2c(cc1NCCCN(C)C)c1n[nH]c(C)c1c(=O)n2CCCN
• InChI: InChI=1S/C24H36N6O2.C21H29N5O2.C20H30N6O.C19H26FN5O2.C16H19ClN4O2/c1-16(14-28(3)4)15-32-21-12-18-19(13-20(21)29-9-5-6-10-29)30(11-7-8-25)24(31)22-17(2)26-27-23(18)22;1-14-19-20(24-23-14)17-13-16(28-12-8-15-5-3-10-25(15)2)6-7-18(17)26(21(19)27)11-4-9-22;1-13-11-17-15(12-16(13)22-8-6-9-25(3)4)19-18(14(2)23-24-19)20(27)26(17)10-5-7-21;1-12-17-18(23-22-12)13-10-16(27-9-5-7-24(2)3)14(20)11-15(13)25(19(17)26)8-4-6-21;1-23-8-5-12-14-15(20-19-12)11-9-10(17)3-4-13(11)21(16(14)22)7-2-6-18/h12-13,16H,5-11,14-15,25H2,1-4H3,(H,26,27);6-7,13,15H,3-5,8-12,22H2,1-2H3,(H,23,24);11-12,22H,5-10,21H2,1-4H3,(H,23,24);10-11H,4-9,21H2,1-3H3,(H,22,23);3-4,9H,2,5-8,18H2,1H3,(H,19,20)
• InChIKey: NHQFWNWRJAPCIC-UHFFFAOYSA-N
• XLogP: 11.39
• TPSA: 448.65 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 30
• Rotatable Bonds: 38
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1904.84
LogP ≤ 5	11.39
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one?

The IUPAC name of 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one (CID 159783321) is 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one.

What is the SMILES notation for 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one?

The canonical SMILES for 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one is COCCc1[nH]nc2c1c(=O)n(CCCN)c1ccc(Cl)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1cc(F)c(OCCCN(C)C)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1cc(N3CCCC3)c(OCC(C)CN(C)C)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(OCCC3CCCN3C)cc21.Cc1cc2c(cc1NCCCN(C)C)c1n[nH]c(C)c1c(=O)n2CCCN.

What is the InChIKey of 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one?

The InChIKey is NHQFWNWRJAPCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36N6O2.C21H29N5O2.C20H30N6O.C19H26FN5O2.C16H19ClN4O2/c1-16(14-28(3)4)15-32-21-12-18-19(13-20(21)29-9-5-6-10-29)30(11-7-8-25)24(31)22-17(2)26-27-23(18)22;1-14-19-20(24-23-14)17-13-16(28-12-8-15-5-3-10-25(15)2)6-7-18(17)26(21(19)27)11-4-9-22;1-13-11-17-15(12-16(13)22-8-6-9-25(3)4)19-18(14(2)23-24-19)20(27)26(17)10-5-7-21;1-12-17-18(23-22-12)13-10-16(27-9-5-7-24(2)3)14(20)11-15(13)25(19(17)26)8-4-6-21;1-23-8-5-12-14-15(20-19-12)11-9-10(17)3-4-13(11)21(16(14)22)7-2-6-18/h12-13,16H,5-11,14-15,25H2,1-4H3,(H,26,27);6-7,13,15H,3-5,8-12,22H2,1-2H3,(H,23,24);11-12,22H,5-10,21H2,1-4H3,(H,23,24);10-11H,4-9,21H2,1-3H3,(H,22,23);3-4,9H,2,5-8,18H2,1H3,(H,19,20).

What are the key properties of 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one?

5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 1904.84 g/mol, XLogP of 11.39, 38 rotatable bonds, 11 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3-aminopropyl)-8-chloro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)-2-methylpropoxy]-3-methyl-7-pyrrolidin-1-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propoxy]-7-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-[3-(dimethylamino)propylamino]-3,7-dimethyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-[2-(1-methylpyrrolidin-2-yl)ethoxy]-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 159783321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).